Toluene → HCID 86644319, 화합물

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[CH2:1]([CH2:2][CH2:3][CH3:4])[O:5][c:6]1[cH:7][c:8]([CH:12]([CH2:13][NH:14][CH2:15][C:16](=[O:17])[N:18]([CH3:19])[CH3:20])[C:21](=[O:22])[O:23][C:24]([CH3:25])([CH3:26])[CH3:27])[cH:9][cH:10][cH:11]1.[CH3:28][O:29][c:30]1[cH:31][cH:32][c:33]([P:34]2(=[S:37])[S:35][P:36]([c:38]3[cH:39][cH:40][c:41]([O:42][CH3:43])[cH:44][cH:45]3)(=[S:46])[S:47]2)[cH:48][cH:49]1.[CH3:50][c:51]1[cH:52][cH:53][cH:54][cH:55][cH:56]1>>[CH2:1]([CH2:2][CH2:3][CH3:4])[O:5][c:6]1[cH:7][c:8]([CH:12]([CH2:13][NH:14][CH2:15][C:16]([N:18]([CH3:19])[CH3:20])=[S:37])[C:21](=[O:22])[O:23][C:24]([CH3:25])([CH3:26])[CH3:27])[cH:9][cH:10][cH:11]1

참가 물질

반응물 3

HCID 1140Toluene

HCID 87949Lawesson's reagent

HCID 68487077HCID 68487077, 화합물

생성물 1

HCID 86644319HCID 86644319, 화합물

출처 및 근거

ORD 기록: ord-7822344b4412475fb9d4d75d958f1a74
출처 데이터셋: Training data from https://doi.org/10.1039/C8SC04228D (3/10)
DOI: 10.1039/C8SC04228D

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